4-(2-fluorophenyl)-N-[(E)-2-(4-fluorophenyl)ethenyl]piperazine-1-carboxamide

C19H19F2N3O — CID 108908210

IUPAC4-(2-fluorophenyl)-N-[(E)-2-(4-fluorophenyl)ethenyl]piperazine-1-carboxamide
SMILESO=C(N/C=C/c1ccc(F)cc1)N1CCN(c2ccccc2F)CC1
InChIInChI=1S/C19H19F2N3O/c20-16-7-5-15(6-8-16)9-10-22-19(25)24-13-11-23(12-14-24)18-4-2-1-3-17(18)21/h1-10H,11-14H2,(H,22,25)/b10-9+
InChIKeyBDKXONSQRCQAGV-MDZDMXLPSA-N
MW343.38 g/mol
LogP3.47
Rot. Bonds3

About 4-(2-fluorophenyl)-N-[(E)-2-(4-fluorophenyl)ethenyl]piperazine-1-carboxamide

4-(2-fluorophenyl)-N-[(E)-2-(4-fluorophenyl)ethenyl]piperazine-1-carboxamide (PubChem CID 108908210) has the molecular formula C19H19F2N3O and a molecular weight of 343.38 g/mol. Its IUPAC name is 4-(2-fluorophenyl)-N-[(E)-2-(4-fluorophenyl)ethenyl]piperazine-1-carboxamide.

Molecular Properties

Compound Name4-(2-fluorophenyl)-N-[(E)-2-(4-fluorophenyl)ethenyl]piperazine-1-carboxamide
PubChem CID108908210
Molecular FormulaC19H19F2N3O
Molecular Weight343.38 g/mol
Exact Mass343.15
IUPAC Name4-(2-fluorophenyl)-N-[(E)-2-(4-fluorophenyl)ethenyl]piperazine-1-carboxamide
SMILESO=C(N/C=C/c1ccc(F)cc1)N1CCN(c2ccccc2F)CC1
InChIInChI=1S/C19H19F2N3O/c20-16-7-5-15(6-8-16)9-10-22-19(25)24-13-11-23(12-14-24)18-4-2-1-3-17(18)21/h1-10H,11-14H2,(H,22,25)/b10-9+
InChIKeyBDKXONSQRCQAGV-MDZDMXLPSA-N
XLogP3.47
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.38
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(2-fluorophenyl)-N-[(E)-2-phenylethenyl]piperazine-1-carboxamide
CID 108903368
N-[(E)-2-(4-fluorophenyl)ethenyl]azepane-1-carboxamide
CID 108908063
N-[(E)-2-(4-bromophenyl)ethenyl]-4-(2-methoxyphenyl)piperazine-1-carboxamide
CID 108908901
ethane;N-[(E)-2-(4-fluorophenyl)ethenyl]-4-formylpiperazine-1-carboxamide;propane
CID 145287461
4-(2-fluorophenyl)-N-methoxypiperazine-1-carboxamide
CID 47139754
4-fluoro-N-[2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl]benzamide
CID 26590726
4-(2,3-dimethylphenyl)-N-[(E)-2-(4-methoxyphenyl)ethenyl]piperazine-1-carboxamide;hydrochloride
CID 108907825
4-acetyl-N-[(E)-2-(4-chlorophenyl)ethenyl]piperazine-1-carboxamide
CID 108908348
N-benzhydryl-4-(2-fluorophenyl)piperazine-1-carboxamide
CID 108867571
3-[(4-fluorophenyl)methylamino]-1-[4-(2-fluorophenyl)piperazin-1-yl]propan-1-one
CID 109021197
1-[4-(2-fluorophenyl)piperazin-1-yl]-2-(4-phenylpiperazin-1-yl)ethane-1,2-dione
CID 108532363
1-[4-(2-fluorophenyl)piperazin-1-yl]-2-pyrrolidin-1-ylethane-1,2-dione
CID 108521142

Frequently Asked Questions

What is the IUPAC name of 4-(2-fluorophenyl)-N-[(E)-2-(4-fluorophenyl)ethenyl]piperazine-1-carboxamide?
The IUPAC name of 4-(2-fluorophenyl)-N-[(E)-2-(4-fluorophenyl)ethenyl]piperazine-1-carboxamide (CID 108908210) is 4-(2-fluorophenyl)-N-[(E)-2-(4-fluorophenyl)ethenyl]piperazine-1-carboxamide.
What is the SMILES notation for 4-(2-fluorophenyl)-N-[(E)-2-(4-fluorophenyl)ethenyl]piperazine-1-carboxamide?
The canonical SMILES for 4-(2-fluorophenyl)-N-[(E)-2-(4-fluorophenyl)ethenyl]piperazine-1-carboxamide is O=C(N/C=C/c1ccc(F)cc1)N1CCN(c2ccccc2F)CC1.
What is the InChIKey of 4-(2-fluorophenyl)-N-[(E)-2-(4-fluorophenyl)ethenyl]piperazine-1-carboxamide?
The InChIKey is BDKXONSQRCQAGV-MDZDMXLPSA-N. The full InChI is InChI=1S/C19H19F2N3O/c20-16-7-5-15(6-8-16)9-10-22-19(25)24-13-11-23(12-14-24)18-4-2-1-3-17(18)21/h1-10H,11-14H2,(H,22,25)/b10-9+.
What are the key properties of 4-(2-fluorophenyl)-N-[(E)-2-(4-fluorophenyl)ethenyl]piperazine-1-carboxamide?
4-(2-fluorophenyl)-N-[(E)-2-(4-fluorophenyl)ethenyl]piperazine-1-carboxamide has a molecular weight of 343.38 g/mol, XLogP of 3.47, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluorophenyl)-N-[(E)-2-(4-fluorophenyl)ethenyl]piperazine-1-carboxamide is sourced from PubChem (CID 108908210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).